N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine

C10H18N4OS2 — CID 17398214

IUPACN-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine
SMILESCCNc1nnc(SCCN2CCOCC2)s1
InChIInChI=1S/C10H18N4OS2/c1-2-11-9-12-13-10(17-9)16-8-5-14-3-6-15-7-4-14/h2-8H2,1H3,(H,11,12)
InChIKeyKDMFVQZZCFHXOE-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.39
Rot. Bonds6

About N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine

N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine (PubChem CID 17398214) has the molecular formula C10H18N4OS2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine
PubChem CID17398214
Molecular FormulaC10H18N4OS2
Molecular Weight274.41 g/mol
Exact Mass274.09
IUPAC NameN-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine
SMILESCCNc1nnc(SCCN2CCOCC2)s1
InChIInChI=1S/C10H18N4OS2/c1-2-11-9-12-13-10(17-9)16-8-5-14-3-6-15-7-4-14/h2-8H2,1H3,(H,11,12)
InChIKeyKDMFVQZZCFHXOE-UHFFFAOYSA-N
XLogP1.39
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine (CID 17398214) is N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine is CCNc1nnc(SCCN2CCOCC2)s1.
What is the InChIKey of N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine?
The InChIKey is KDMFVQZZCFHXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4OS2/c1-2-11-9-12-13-10(17-9)16-8-5-14-3-6-15-7-4-14/h2-8H2,1H3,(H,11,12).
What are the key properties of N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine?
N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine has a molecular weight of 274.41 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-morpholin-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 17398214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).